methyl 2-ethyl-4-methyl-5-(1-phenylethylcarbamoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-4-methyl-5-(1-phenylethylcarbamoyl)-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-4-methyl-5-(1-phenylethylcarbamoyl)-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-4-methyl-5-[oxo-(1-phenylethylamino)methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-methyl-5-(1-phenylethylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-4-methyl-5-(1-phenylethylcarbamoyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H22N2O3 MolecularWeight: 314.37888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC(C)C2=CC=CC=C2)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC(C)C2=CC=CC=C2)C)C(=O)OC

InChI

InChI=1S/C18H22N2O3/c1-5-14-15(18(22)23-4)11(2)16(20-14)17(21)19-12(3)13-9-7-6-8-10-13/h6-10,12,20H,5H2,1-4H3,(H,19,21)